Browsing Facultat de Química by Subject "544"

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Multiscale modelling of CO2 hydrogenation reactions on Ni-based catalysts

Lozano Reis, Pablo (Date of defense: 2023-11-10)

[eng] Global warming and climate change, mostly due to the increasing concentration of greenhouse gases in the atmosphere, are producing devastating effects. Among the different greenhouse gases, CO2 is one of the major ...

MXene Materials for CO(2) Capture and Transformation

Jurado Mañas, Anabel (Date of defense: 2023-06-21)

[eng] MXene materials, the low-dimensional counterpart of transition metal carbides and nitrides present suitable properties as catalysts in heterogeneous catalysis given the similar properties with transition metal carbides ...

Protein Flexibility: From local to global motions. A computational study

Sánchez Martínez, Melchor (Date of defense: 2014-12-09)

Proteins are flexible entities, and thus move. Its function is closely related to the flexibility. To carry out any function is necessary a conformational change. As protein motions imply an exchange of conformations, ...